phenethyl 4-[(4-butan-2-yloxyphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[(4-butan-2-yloxyphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-oxo-4-(4-sec-butoxyanilino)butanoate CAS Name: 4-(4-butan-2-yloxyanilino)-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-(4-butan-2-yloxyanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(4-sec-butoxyanilino)butyric acid phenethyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)NC(=O)CCC(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)NC(=O)CCC(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C22H27NO4/c1-3-17(2)27-20-11-9-19(10-12-20)23-21(24)13-14-22(25)26-16-15-18-7-5-4-6-8-18/h4-12,17H,3,13-16H2,1-2H3,(H,23,24)